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	hartrees
Energy at 0K	-475.810545
Energy at 298.15K	-475.814551
HF Energy	-474.709929
Nuclear repulsion energy	264.603030

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3151	3039	0.00
2	A_g	1494	1441	0.00
3	A_g	1183	1141	0.00
4	A_g	1117	1077	0.00
5	A_g	622	600	0.00
6	A_g	361	348	0.00
7	A_u	1357	1309	34.26
8	A_u	1170	1128	389.12
9	A_u	206	199	2.10
10	A_u	89	85	2.57
11	B_g	1388	1339	0.00
12	B_g	1136	1096	0.00
13	B_g	486	469	0.00
14	B_u	3159	3047	28.90
15	B_u	1323	1276	27.18
16	B_u	1140	1099	219.62
17	B_u	534	515	10.38
18	B_u	411	397	51.88

Atom	x (Å)	y (Å)	z (Å)
C1	-0.249	0.722	0.000
C2	0.249	-0.722	0.000
H3	-1.347	0.791	0.000
H4	1.347	-0.791	0.000
F5	0.249	1.352	1.104
F6	0.249	1.352	-1.104
F7	-0.249	-1.352	1.104
F8	-0.249	-1.352	-1.104

	C1	C2	H3	H4	F5	F6	F7	F8
C1		1.5276	1.1005	2.1989	1.3651	1.3651	2.3498	2.3498
C2	1.5276		2.1989	1.1005	2.3498	2.3498	1.3651	1.3651
H3	1.1005	2.1989		3.1240	2.0201	2.0201	2.6489	2.6489
H4	2.1989	1.1005	3.1240		2.6489	2.6489	2.0201	2.0201
F5	1.3651	2.3498	2.0201	2.6489		2.2086	2.7493	3.5265
F6	1.3651	2.3498	2.0201	2.6489	2.2086		3.5265	2.7493
F7	2.3498	1.3651	2.6489	2.0201	2.7493	3.5265		2.2086
F8	2.3498	1.3651	2.6489	2.0201	3.5265	2.7493	2.2086

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	112.574	C1	C2	F7	108.516
C1	C2	F8	108.516	C2	C1	H3	112.574
C2	C1	F5	108.516	C2	C1	F6	108.516
H3	C1	F5	109.567	H3	C1	F6	109.567
H4	C2	F7	109.567	H4	C2	F8	109.567
F5	C1	F6	107.987	F7	C2	F8	107.987

All results from a given calculation for CHF₂CHF₂ (1,1,2,2-tetrafluoroethane)

using model chemistry: CCD/aug-cc-pVDZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CHF2CHF2 (1,1,2,2-tetrafluoroethane)

using model chemistry: CCD/aug-cc-pVDZ

States and conformations

All results from a given calculation for CHF₂CHF₂ (1,1,2,2-tetrafluoroethane)